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BDBM50455967 CHEMBL37239

SMILES: OC(=O)\C=C/C(O)=O.CC(C)Oc1ccccc1C(=O)NC(=O)NC1CC2CCC(C1)N2C

InChI Key: InChIKey=OZLWJCIOVDGYDV-BTJKTKAUSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50455967   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)		BDBM50455967
PNG
(CHEMBL37239)
Show SMILES OC(=O)\C=C/C(O)=O.CC(C)Oc1ccccc1C(=O)NC(=O)NC1CC2CCC(C1)N2C |TLB:23:24:31:27.28|
Show InChI InChI=1S/C19H27N3O3.C4H4O4/c1-12(2)25-17-7-5-4-6-16(17)18(23)21-19(24)20-13-10-14-8-9-15(11-13)22(14)3;5-3(6)1-2-4(7)8/h4-7,12-15H,8-11H2,1-3H3,(H2,20,21,23,24);1-2H,(H,5,6)(H,7,8)/b;2-1-
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/an/a 0.631n/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
In vitro antagonism of the 5-HT-3 receptor determined by inhibition of 5-HT-induced depolarization of the isolated rat vagus nerve.

J Med Chem 35: 1515-20 (1992)


BindingDB Entry DOI: 10.7270/Q24B32SK
More data for this
Ligand-Target Pair